Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Acetophenone, 2-(1-imidazolyl)-4'-methoxy-, nitrate
RN: 24155-39-3
InChIKey: IMHJHBQYKOTFIG-UHFFFAOYSA-O

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H12-N2-O2.H-N-O3

Molecular Weight

  • 279.251
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • N-(4-Methoxyphenacyl)imidazole nitrate

Systematic Name

  • Acetophenone, 2-(1-imidazolyl)-4'-methoxy-, nitrate

Registry Numbers

CAS Registry Number

  • 24155-39-3

System Generated Number

  • 0024155393

Molecular Formulas

Molecular Formula

  • C12-H12-N2-O2.H-N-O3

Molecular Formula Fragments

  • C12-H12-N2-O2
  • COMPONENT
  • H-N-O3

Structure Descriptors

InChI

1S/C12H12N2O2.NO3/c1-16-11-4-2-10(3-5-11)12(15)8-14-7-6-13-9-14;2-1(3)4/h2-7,9H,8H2,1H3;/q;-1/p+1

InChIKey

IMHJHBQYKOTFIG-UHFFFAOYSA-O

Smiles

c1(C(=O)C[N+]2C=CN=C2)ccc(OC)cc1.[N+](=O)([O-])[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 270mg/kg (270mg/kg)   Journal of Medicinal Chemistry. Vol. 24, Pg. 727, 1981.